Compound Identification
SMILES
CC(=NNC(=O)C1=CC=C(NCC2=CC=C(Cl)C=C2)C=C1)C1=CC=C(Br)C=C1
InChIKey
InChIKey=WEDRPXNOJVOLBM-UHFFFAOYSA-N
Formula
C22H19BrClN3O
Mass
456.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
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Subclass
Phenylmethylamines
- Level 5 Phenylbenzamines
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Subclass
Phenylmethylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbenzamines
Alternative Parents
Aminobenzoic acids and derivatives Phenylalkylamines Aniline and substituted anilines Benzoyl derivatives Benzylamines Secondary alkylarylamines Bromobenzenes Chlorobenzenes Aryl bromides Aryl chlorides Amino acids and derivatives Organobromides Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylbenzamine - Aminobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Benzylamine - Phenylalkylamine - Aniline or substituted anilines - Bromobenzene - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aralkylamine - Aryl bromide - Aryl chloride - Aryl halide - Amino acid or derivatives - Secondary amine - Carboxylic acid derivative - Organochloride - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organobromide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
External Descriptors
Not available